COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.547   3.077   2.334  1.00  0.00           O  
HETATM    2  C   UNL     1      21.329  -7.824  -0.957  1.00  0.00           C  
HETATM    3  C   UNL     1      20.353  -7.089  -0.036  1.00  0.00           C  
HETATM    4  C   UNL     1      19.094  -6.715  -0.821  1.00  0.00           C  
HETATM    5  C   UNL     1      18.118  -5.980   0.100  1.00  0.00           C  
HETATM    6  C   UNL     1      16.859  -5.606  -0.685  1.00  0.00           C  
HETATM    7  C   UNL     1      15.883  -4.871   0.236  1.00  0.00           C  
HETATM    8  C   UNL     1      14.624  -4.497  -0.549  1.00  0.00           C  
HETATM    9  C   UNL     1      13.648  -3.763   0.372  1.00  0.00           C  
HETATM   10  C   UNL     1      12.389  -3.388  -0.413  1.00  0.00           C  
HETATM   11  C   UNL     1      11.414  -2.654   0.508  1.00  0.00           C  
HETATM   12  C   UNL     1      10.155  -2.280  -0.277  1.00  0.00           C  
HETATM   13  C   UNL     1       9.179  -1.545   0.644  1.00  0.00           C  
HETATM   14  C   UNL     1       7.920  -1.171  -0.141  1.00  0.00           C  
HETATM   15  C   UNL     1       6.944  -0.436   0.780  1.00  0.00           C  
HETATM   16  C   UNL     1       5.685  -0.062  -0.005  1.00  0.00           C  
HETATM   17  C   UNL     1       4.709   0.673   0.916  1.00  0.00           C  
HETATM   18  C   UNL     1       3.450   1.047   0.131  1.00  0.00           C  
HETATM   19  C   UNL     1       2.474   1.782   1.052  1.00  0.00           C  
HETATM   20  C   UNL     1       1.216   2.156   0.267  1.00  0.00           C  
HETATM   21  C   UNL     1       0.254   2.880   1.174  1.00  0.00           C  
HETATM   22  N   UNL     1      -0.931   3.308   0.696  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.865   4.012   1.578  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.509   5.499   1.615  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.697   6.067   0.318  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.391   7.460   0.243  1.00  0.00           C  
HETATM   27  O   UNL     1       0.021   7.646   0.368  1.00  0.00           O  
HETATM   28  C   UNL     1       0.788   6.970  -0.630  1.00  0.00           C  
HETATM   29  C   UNL     1       2.278   7.215  -0.380  1.00  0.00           C  
HETATM   30  O   UNL     1       2.658   6.614   0.859  1.00  0.00           O  
HETATM   31  C   UNL     1       0.408   7.504  -2.013  1.00  0.00           C  
HETATM   32  O   UNL     1       0.726   8.895  -2.092  1.00  0.00           O  
HETATM   33  C   UNL     1      -1.096   7.310  -2.231  1.00  0.00           C  
HETATM   34  O   UNL     1      -1.473   7.872  -3.489  1.00  0.00           O  
HETATM   35  C   UNL     1      -1.859   8.014  -1.105  1.00  0.00           C  
HETATM   36  O   UNL     1      -3.260   7.779  -1.258  1.00  0.00           O  
HETATM   37  C   UNL     1      -3.291   3.842   1.050  1.00  0.00           C  
HETATM   38  O   UNL     1      -4.187   4.632   1.834  1.00  0.00           O  
HETATM   39  C   UNL     1      -3.697   2.369   1.141  1.00  0.00           C  
HETATM   40  O   UNL     1      -2.801   1.579   0.356  1.00  0.00           O  
HETATM   41  C   UNL     1      -5.122   2.199   0.613  1.00  0.00           C  
HETATM   42  C   UNL     1      -5.573   0.752   0.819  1.00  0.00           C  
HETATM   43  C   UNL     1      -6.999   0.581   0.291  1.00  0.00           C  
HETATM   44  C   UNL     1      -7.443  -0.844   0.493  1.00  0.00           C  
HETATM   45  O   UNL     1      -6.693  -1.646   1.009  1.00  0.00           O  
HETATM   46  N   UNL     1      -8.674  -1.229   0.101  1.00  0.00           N  
HETATM   47  C   UNL     1      -9.106  -2.615   0.298  1.00  0.00           C  
HETATM   48  C   UNL     1     -10.531  -2.785  -0.230  1.00  0.00           C  
HETATM   49  C   UNL     1     -10.982  -4.233  -0.024  1.00  0.00           C  
HETATM   50  C   UNL     1     -12.408  -4.403  -0.552  1.00  0.00           C  
HETATM   51  C   UNL     1     -12.859  -5.850  -0.347  1.00  0.00           C  
HETATM   52  C   UNL     1     -14.285  -6.020  -0.874  1.00  0.00           C  
HETATM   53  C   UNL     1     -14.729  -7.446  -0.672  1.00  0.00           C  
HETATM   54  C   UNL     1     -14.494  -8.389  -1.655  1.00  0.00           C  
HETATM   55  C   UNL     1     -14.897  -9.698  -1.467  1.00  0.00           C  
HETATM   56  C   UNL     1     -15.534 -10.064  -0.296  1.00  0.00           C  
HETATM   57  C   UNL     1     -15.769  -9.121   0.687  1.00  0.00           C  
HETATM   58  C   UNL     1     -15.366  -7.812   0.499  1.00  0.00           C  
HETATM   59  H   UNL     1      22.226  -8.090  -0.398  1.00  0.00           H  
HETATM   60  H   UNL     1      20.856  -8.729  -1.339  1.00  0.00           H  
HETATM   61  H   UNL     1      21.599  -7.176  -1.791  1.00  0.00           H  
HETATM   62  H   UNL     1      20.082  -7.737   0.797  1.00  0.00           H  
HETATM   63  H   UNL     1      20.825  -6.184   0.345  1.00  0.00           H  
HETATM   64  H   UNL     1      19.365  -6.067  -1.655  1.00  0.00           H  
HETATM   65  H   UNL     1      18.622  -7.620  -1.203  1.00  0.00           H  
HETATM   66  H   UNL     1      17.847  -6.628   0.933  1.00  0.00           H  
HETATM   67  H   UNL     1      18.590  -5.075   0.481  1.00  0.00           H  
HETATM   68  H   UNL     1      17.130  -4.958  -1.519  1.00  0.00           H  
HETATM   69  H   UNL     1      16.387  -6.511  -1.067  1.00  0.00           H  
HETATM   70  H   UNL     1      15.612  -5.519   1.069  1.00  0.00           H  
HETATM   71  H   UNL     1      16.355  -3.966   0.618  1.00  0.00           H  
HETATM   72  H   UNL     1      14.895  -3.849  -1.383  1.00  0.00           H  
HETATM   73  H   UNL     1      14.152  -5.403  -0.931  1.00  0.00           H  
HETATM   74  H   UNL     1      13.378  -4.411   1.205  1.00  0.00           H  
HETATM   75  H   UNL     1      14.121  -2.857   0.754  1.00  0.00           H  
HETATM   76  H   UNL     1      12.660  -2.741  -1.247  1.00  0.00           H  
HETATM   77  H   UNL     1      11.917  -4.294  -0.795  1.00  0.00           H  
HETATM   78  H   UNL     1      11.143  -3.302   1.341  1.00  0.00           H  
HETATM   79  H   UNL     1      11.886  -1.748   0.890  1.00  0.00           H  
HETATM   80  H   UNL     1      10.425  -1.632  -1.111  1.00  0.00           H  
HETATM   81  H   UNL     1       9.682  -3.185  -0.659  1.00  0.00           H  
HETATM   82  H   UNL     1       8.908  -2.193   1.477  1.00  0.00           H  
HETATM   83  H   UNL     1       9.651  -0.640   1.026  1.00  0.00           H  
HETATM   84  H   UNL     1       8.191  -0.523  -0.975  1.00  0.00           H  
HETATM   85  H   UNL     1       7.448  -2.076  -0.523  1.00  0.00           H  
HETATM   86  H   UNL     1       6.673  -1.084   1.613  1.00  0.00           H  
HETATM   87  H   UNL     1       7.416   0.469   1.162  1.00  0.00           H  
HETATM   88  H   UNL     1       5.956   0.586  -0.839  1.00  0.00           H  
HETATM   89  H   UNL     1       5.213  -0.967  -0.387  1.00  0.00           H  
HETATM   90  H   UNL     1       4.438   0.025   1.750  1.00  0.00           H  
HETATM   91  H   UNL     1       5.182   1.578   1.298  1.00  0.00           H  
HETATM   92  H   UNL     1       3.721   1.695  -0.703  1.00  0.00           H  
HETATM   93  H   UNL     1       2.978   0.142  -0.251  1.00  0.00           H  
HETATM   94  H   UNL     1       2.204   1.134   1.885  1.00  0.00           H  
HETATM   95  H   UNL     1       2.947   2.687   1.434  1.00  0.00           H  
HETATM   96  H   UNL     1       1.486   2.804  -0.567  1.00  0.00           H  
HETATM   97  H   UNL     1       0.743   1.251  -0.115  1.00  0.00           H  
HETATM   98  H   UNL     1      -1.165   3.150  -0.232  1.00  0.00           H  
HETATM   99  H   UNL     1      -1.798   3.596   2.584  1.00  0.00           H  
HETATM  100  H   UNL     1      -2.154   6.009   2.332  1.00  0.00           H  
HETATM  101  H   UNL     1      -0.468   5.616   1.916  1.00  0.00           H  
HETATM  102  H   UNL     1      -1.900   7.988   1.049  1.00  0.00           H  
HETATM  103  H   UNL     1       0.583   5.900  -0.584  1.00  0.00           H  
HETATM  104  H   UNL     1       2.859   6.776  -1.191  1.00  0.00           H  
HETATM  105  H   UNL     1       2.467   8.288  -0.337  1.00  0.00           H  
HETATM  106  H   UNL     1       3.592   6.730   1.082  1.00  0.00           H  
HETATM  107  H   UNL     1       0.961   6.960  -2.779  1.00  0.00           H  
HETATM  108  H   UNL     1       0.511   9.300  -2.943  1.00  0.00           H  
HETATM  109  H   UNL     1      -1.331   6.245  -2.222  1.00  0.00           H  
HETATM  110  H   UNL     1      -2.415   7.784  -3.693  1.00  0.00           H  
HETATM  111  H   UNL     1      -1.662   9.086  -1.147  1.00  0.00           H  
HETATM  112  H   UNL     1      -3.805   8.193  -0.575  1.00  0.00           H  
HETATM  113  H   UNL     1      -3.335   4.167   0.011  1.00  0.00           H  
HETATM  114  H   UNL     1      -4.145   4.449   2.783  1.00  0.00           H  
HETATM  115  H   UNL     1      -3.653   2.044   2.180  1.00  0.00           H  
HETATM  116  H   UNL     1      -2.788   1.814  -0.581  1.00  0.00           H  
HETATM  117  H   UNL     1      -5.792   2.868   1.153  1.00  0.00           H  
HETATM  118  H   UNL     1      -5.148   2.440  -0.450  1.00  0.00           H  
HETATM  119  H   UNL     1      -4.904   0.082   0.279  1.00  0.00           H  
HETATM  120  H   UNL     1      -5.548   0.511   1.882  1.00  0.00           H  
HETATM  121  H   UNL     1      -7.669   1.251   0.831  1.00  0.00           H  
HETATM  122  H   UNL     1      -7.024   0.822  -0.772  1.00  0.00           H  
HETATM  123  H   UNL     1      -9.274  -0.588  -0.311  1.00  0.00           H  
HETATM  124  H   UNL     1      -8.436  -3.284  -0.242  1.00  0.00           H  
HETATM  125  H   UNL     1      -9.081  -2.856   1.361  1.00  0.00           H  
HETATM  126  H   UNL     1     -11.201  -2.116   0.310  1.00  0.00           H  
HETATM  127  H   UNL     1     -10.557  -2.544  -1.293  1.00  0.00           H  
HETATM  128  H   UNL     1     -10.313  -4.902  -0.564  1.00  0.00           H  
HETATM  129  H   UNL     1     -10.957  -4.473   1.039  1.00  0.00           H  
HETATM  130  H   UNL     1     -13.078  -3.733  -0.012  1.00  0.00           H  
HETATM  131  H   UNL     1     -12.433  -4.162  -1.615  1.00  0.00           H  
HETATM  132  H   UNL     1     -12.189  -6.519  -0.887  1.00  0.00           H  
HETATM  133  H   UNL     1     -12.834  -6.091   0.716  1.00  0.00           H  
HETATM  134  H   UNL     1     -14.955  -5.351  -0.335  1.00  0.00           H  
HETATM  135  H   UNL     1     -14.310  -5.779  -1.937  1.00  0.00           H  
HETATM  136  H   UNL     1     -13.996  -8.104  -2.569  1.00  0.00           H  
HETATM  137  H   UNL     1     -14.714 -10.435  -2.235  1.00  0.00           H  
HETATM  138  H   UNL     1     -15.849 -11.086  -0.149  1.00  0.00           H  
HETATM  139  H   UNL     1     -16.267  -9.406   1.602  1.00  0.00           H  
HETATM  140  H   UNL     1     -15.546  -7.076   1.269  1.00  0.00           H  
CONECT    1   21   21                                                 
CONECT    2    3   59   60   61                                       
CONECT    3    2    4   62   63                                       
CONECT    4    3    5   64   65                                       
CONECT    5    4    6   66   67                                       
CONECT    6    5    7   68   69                                       
CONECT    7    6    8   70   71                                       
CONECT    8    9    7   72   73                                       
CONECT    9   10    8   74   75                                       
CONECT   10   11    9   76   77                                       
CONECT   11   12   10   78   79                                       
CONECT   12   13   11   80   81                                       
CONECT   13   12   14   82   83                                       
CONECT   14   15   13   84   85                                       
CONECT   15   14   16   86   87                                       
CONECT   16   15   17   88   89                                       
CONECT   17   16   18   90   91                                       
CONECT   18   17   19   92   93                                       
CONECT   19   18   20   94   95                                       
CONECT   20   19   21   96   97                                       
CONECT   21    1    1   22   20                                       
CONECT   22   23   21   98                                            
CONECT   23   37   22   24   99                                       
CONECT   24   23   25  100  101                                       
CONECT   25   24   26                                                 
CONECT   26   25   35   27  102                                       
CONECT   27   26   28                                                 
CONECT   28   31   27   29  103                                       
CONECT   29   28   30  104  105                                       
CONECT   30   29  106                                                 
CONECT   31   33   28   32  107                                       
CONECT   32   31  108                                                 
CONECT   33   35   34   31  109                                       
CONECT   34   33  110                                                 
CONECT   35   36   26   33  111                                       
CONECT   36   35  112                                                 
CONECT   37   39   38   23  113                                       
CONECT   38   37  114                                                 
CONECT   39   41   40   37  115                                       
CONECT   40   39  116                                                 
CONECT   41   42   39  117  118                                       
CONECT   42   43   41  119  120                                       
CONECT   43   44   42  121  122                                       
CONECT   44   46   45   45   43                                       
CONECT   45   44   44                                                 
CONECT   46   47   44  123                                            
CONECT   47   48   46  124  125                                       
CONECT   48   49   47  126  127                                       
CONECT   49   50   48  128  129                                       
CONECT   50   51   49  130  131                                       
CONECT   51   52   50  132  133                                       
CONECT   52   53   51  134  135                                       
CONECT   53   54   54   58   52                                       
CONECT   54   55   53   53  136                                       
CONECT   55   56   56   54  137                                       
CONECT   56   55   55   57  138                                       
CONECT   57   56   58   58  139                                       
CONECT   58   57   57   53  140                                       
CONECT   59    2                                                      
CONECT   60    2                                                      
CONECT   61    2                                                      
CONECT   62    3                                                      
CONECT   63    3                                                      
CONECT   64    4                                                      
CONECT   65    4                                                      
CONECT   66    5                                                      
CONECT   67    5                                                      
CONECT   68    6                                                      
CONECT   69    6                                                      
CONECT   70    7                                                      
CONECT   71    7                                                      
CONECT   72    8                                                      
CONECT   73    8                                                      
CONECT   74    9                                                      
CONECT   75    9                                                      
CONECT   76   10                                                      
CONECT   77   10                                                      
CONECT   78   11                                                      
CONECT   79   11                                                      
CONECT   80   12                                                      
CONECT   81   12                                                      
CONECT   82   13                                                      
CONECT   83   13                                                      
CONECT   84   14                                                      
CONECT   85   14                                                      
CONECT   86   15                                                      
CONECT   87   15                                                      
CONECT   88   16                                                      
CONECT   89   16                                                      
CONECT   90   17                                                      
CONECT   91   17                                                      
CONECT   92   18                                                      
CONECT   93   18                                                      
CONECT   94   19                                                      
CONECT   95   19                                                      
CONECT   96   20                                                      
CONECT   97   20                                                      
CONECT   98   22                                                      
CONECT   99   23                                                      
CONECT  100   24                                                      
CONECT  101   24                                                      
CONECT  102   26                                                      
CONECT  103   28                                                      
CONECT  104   29                                                      
CONECT  105   29                                                      
CONECT  106   30                                                      
CONECT  107   31                                                      
CONECT  108   32                                                      
CONECT  109   33                                                      
CONECT  110   34                                                      
CONECT  111   35                                                      
CONECT  112   36                                                      
CONECT  113   37                                                      
CONECT  114   38                                                      
CONECT  115   39                                                      
CONECT  116   40                                                      
CONECT  117   41                                                      
CONECT  118   41                                                      
CONECT  119   42                                                      
CONECT  120   42                                                      
CONECT  121   43                                                      
CONECT  122   43                                                      
CONECT  123   46                                                      
CONECT  124   47                                                      
CONECT  125   47                                                      
CONECT  126   48                                                      
CONECT  127   48                                                      
CONECT  128   49                                                      
CONECT  129   49                                                      
CONECT  130   50                                                      
CONECT  131   50                                                      
CONECT  132   51                                                      
CONECT  133   51                                                      
CONECT  134   52                                                      
CONECT  135   52                                                      
CONECT  136   54                                                      
CONECT  137   55                                                      
CONECT  138   56                                                      
CONECT  139   57                                                      
CONECT  140   58                                                      
MASTER        0    0    0    0    0    0    0    0  140    0  140    0
END
